(4-acetamidophenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium

Systemtic Name: (4-acetamidophenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Openeye Name: (4-acetamidophenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium CAS Name: (4-acetamidophenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium IUPAC Name: (4-acetamidophenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Traditional Name: (4-acetamidobenzyl)-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH2+]C2CC(CC3=C2C=NN3C4=CC=C(C=C4)OC)(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH2+][C@@H]2CC(CC3=C2C=NN3C4=CC=C(C=C4)OC)(C)C

InChI

InChI=1S/C25H30N4O2/c1-17(30)28-19-7-5-18(6-8-19)15-26-23-13-25(2,3)14-24-22(23)16-27-29(24)20-9-11-21(31-4)12-10-20/h5-12,16,23,26H,13-15H2,1-4H3,(H,28,30)/p+1/t23-/m1/s1